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CHEBI:208054 - Nocardiopsistin B

ChEBI IDCHEBI:208054
ChEBI NameNocardiopsistin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H16O7
Net Charge0
Average Mass380.352
Monoisotopic Mass380.08960
SMILESCC(C)[C@@]1(O)CC(=O)c2c(cc(O)c3c2C(=O)c2cccc(O)c2C3=O)C1=O
InChIInChI=1S/C21H16O7/c1-8(2)21(28)7-13(24)14-10(20(21)27)6-12(23)16-17(14)18(25)9-4-3-5-11(22)15(9)19(16)26/h3-6,8,22-23,28H,7H2,1-2H3/t21-/m0/s1
InChIKeyQGYKATBWAIDMKB-NRFANRHFSA-N
Species of MetaboliteComponentSourceComments
Nocardiopsis (ncbitaxon:2013) - PubMed (30417139)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
Nocardiopsistin B (CHEBI:208054) is a angucycline (CHEBI:48130)
IUPAC Name 
3,6,8-trihydroxy-3-propan-2-yl-2H-benzo[a]anthracene-1,4,7,12-tetrone
Manual XrefsDatabases
71048553ChemSpider